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CHEBI:132747 - N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid

ChEBI IDCHEBI:132747
ChEBI NameN-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid
Stars
ASCII NameN-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-gamma-aminobutyric acid
DefinitionAn N-acyl-γ-aminobutyric acid resulting from the formal condensation of the amino group of γ-aminobutyric acid with the carboxy group of (15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoic acid.
Last Modified25 August 2020
SubmitterSteve
DownloadsMolfile
FormulaC24H39NO5
Net Charge0
Average Mass421.578
Monoisotopic Mass421.28282
SMILESCCCCC[C@@H](/C=C/C=C\C/C=C\C/C=C\CCCC(=O)NCCCC(=O)O)OO
InChIInChI=1S/C24H39NO5/c1-2-3-13-17-22(30-29)18-14-11-9-7-5-4-6-8-10-12-15-19-23(26)25-21-16-20-24(27)28/h4-5,8-11,14,18,22,29H,2-3,6-7,12-13,15-17,19-21H2,1H3,(H,25,26)(H,27,28)/b5-4-,10-8-,11-9-,18-14+/t22-/m0/s1
InChIKeyMGNPEOZYWFYMNH-ORLNMRMGSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
mammalian metabolite  Any animal metabolite produced during a metabolic reaction in mammals.
ChEBI Ontology
Outgoing Relation(s)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747) has functional parent 15(S)-HPETE (CHEBI:15628)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747) has role mammalian metabolite (CHEBI:75768)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747) is a N-acyl-γ-aminobutyric acid (CHEBI:134018)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747) is a hydroperoxy fatty amide (CHEBI:156403)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747) is conjugate acid of N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate (CHEBI:132078)
Incoming Relation(s)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate (CHEBI:132078) is conjugate base of N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747)
IUPAC Name 
4-{[(5Z,8Z,11Z,13E,15S)-15-hydroperoxyicosa-5,8,11,13-tetraenoyl]amino}butanoic acid
Synonyms  Source
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-eicosatetraenoyl]-γ-aminobutanoic acidChEBI
N-[15(S)-HPETE]-γ-aminobutanoic acidChEBI
N-15-(S)-HPETE-GABAChEBI
N-[15(S)-HPETE]-γ-aminobutyric acidChEBI
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-eicosatetraenoyl]-γ-aminobutyric acidChEBI
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutanoic acidChEBI
Citations